[4-(3-phenylpropyl)-1-(thian-4-yl)piperidin-1-ium-4-yl]methanol

Systemtic Name: [4-(3-phenylpropyl)-1-(thian-4-yl)piperidin-1-ium-4-yl]methanol Openeye Name: [4-(3-phenylpropyl)-1-tetrahydrothiopyran-4-yl-piperidin-1-ium-4-yl]methanol CAS Name: [4-(3-phenylpropyl)-1-(4-thianyl)-4-piperidin-1-iumyl]methanol IUPAC Name: [4-(3-phenylpropyl)-1-(thian-4-yl)piperidin-1-ium-4-yl]methanol Traditional Name: [4-(3-phenylpropyl)-1-tetrahydrothiopyran-4-yl-piperidin-1-ium-4-yl]methanol Formula: C20H32NOS+ MolecularWeight: 334.53918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CSCCC1[NH+]2CCC(CC2)(CCCC3=CC=CC=C3)CO

Isomeric SMILES

C1CSCCC1[NH+]2CCC(CC2)(CCCC3=CC=CC=C3)CO

InChI

InChI=1S/C20H31NOS/c22-17-20(10-4-7-18-5-2-1-3-6-18)11-13-21(14-12-20)19-8-15-23-16-9-19/h1-3,5-6,19,22H,4,7-17H2/p+1